UCSF

ZINC00478651

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 18 No

Other Names:

MFCD00552204

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.60 2.01 -7.26 0 6 0 91 241.206 3
Lo Low (pH 4.5-6) 2.60 2.59 -39.82 1 6 1 92 242.214 3

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )